1748-0418 Screening compound: 1-[(diphenylmethyl)({2-[(diphenylmethyl)(2-hydroxy-3-phenoxypropyl)amino]ethyl})amino]-3-phenoxypropan-2-ol

1748-0418 Screening compound: 1-[(diphenylmethyl)({2-[(diphenylmethyl)(2-hydroxy-3-phenoxypropyl)amino]ethyl})amino]-3-phenoxypropan-2-ol
1748-0418 Screening compound: 1-[(diphenylmethyl)({2-[(diphenylmethyl)(2-hydroxy-3-phenoxypropyl)amino]ethyl})amino]-3-phenoxypropan-2-ol alternative view

Chemical Structure Depiction of ChemDiv screening compound 1748-0418
1-[(diphenylmethyl)({2-[(diphenylmethyl)(2-hydroxy-3-phenoxypropyl)amino]ethyl})amino]-3-phenoxypropan-2-ol

Available from 1 mg

Formats:

  • Glass Vials (4ml Glass Vials VWR #97047-678)
  • 96-tube racks (Matrix #4247 96-well 1.4ml sealed with capmats, empty cols 1 & 12, 100uL of 10mM)

Shiptime: 1 week worldwide delivery in most cases

Compound Identifiers

ChemDiv Compound ID

1748-0418

Molecular Formula

C46H48N2O4 (C46 H48 N2 O4)

Compound Name

1-[(diphenylmethyl)({2-[(diphenylmethyl)(2-hydroxy-3-phenoxypropyl)amino]ethyl})amino]-3-phenoxypropan-2-ol

IUPAC name

1-[(diphenylmethyl)({2-[(diphenylmethyl)(2-hydroxy-3-phenoxypropyl)amino]ethyl})amino]-3-phenoxypropan-2-ol

SMILES

OC(CN(CCN(CC(COc1ccccc1)O)C(c1ccccc1)c1ccccc1)C(c1ccccc1)c1ccccc1)COc1ccccc1

InChI

InChI=1S/C46H48N2O4/c49-41(35-51-43-27-15-5-16-28-43)33-47(45(37-19-7-1-8-20-37)38-21-9-2-10-22-38)31-32-48(34-42(50)36-52-44-29-17-6-18-30-44)46(39-23-11-3-12-24-39)40-25-13-4-14-26-40/h1-30,41-42,45-46,49-50H,31-36H2

InChI Key

BMNASIGFPCNXFN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01532511

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

692.9

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

19.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

9.335

Distribution Coefficient, logD

9.329

Water Solubility, LogSw

-6.20

Polar Surface Area

52.793

Acid Dissociation Constant (pKa)

16.26

Base Dissociation Constant (pKb)

5.50

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

21.70

1748-0418 in Drug Discovery

Included in Screening Libraries

Frequent Hitters Library (7624 compounds)

Included in 1.7M Stock Database

Structure:
  • Pool

References: we are preparing a list of scientific research reports with 1748-0418 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1748-0418?
Check Price and Availability of 1748-0418, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of 1748-0418 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1748-0418
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1748-0418
  • 0.5–50 mg of dry powder sample in single glass vials, custom vials
  • DMSO solutions frozen 10μl–250μl@10mM (96 and 384 format)

Custom synthesis of 1748-0418 available by request